Effects of Mn and Co Doping on the Electronic Structure and Optical Properties of Cu₂ZnSnS₄

The electronic structures and optical properties of Mn-doped, Co-doped, and (Mn,Co)-co-doped Cu₂ZnSnS₄ were calculated and analyzed using the first-principles pseudopotential plane-wave approach. The results indicate that doping with Mn or Co increases the bond population and d...

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Detalhes bibliográficos

Principais autores:	Xiufan Yang, Xinmao Qin, Wanjun Yan, Chunhong Zhang, Dianxi Zhang
Formato:	Artigo
Idioma:	Inglês
Publicado em:	MDPI AG 2025-08-01
coleção:	Crystals
Assuntos:	Cu<sub>2</sub>ZnSnS<sub>4</sub> Mn-doping Co-doping electronic structure optical properties first principles
Acesso em linha:	https://www.mdpi.com/2073-4352/15/9/781
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